Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | PIM1 | P11309 | 1/20 | 0.48 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL31500101 | 1.00 | GAA (0.53) | GAADRD2DRD3PIM1CYP11B2 | |
| SCHEMBL31700253 | 0.95 | GAA (0.58) | GAADRD2DRD3PIM1CYP11B2 | |
| SCHEMBL306879 | 0.95 | GAA (0.58) | GAADRD2DRD3PIM1CYP11B2 | |
| SCHEMBL22797004 | 0.88 | CYP11B2 (0.54) | GAADRD2DRD3CYP11B2CYP11B1 | |
| Trifluoroacetic Acid SCHEMBL12494588 | 0.87 | ALDH1A1 (0.45) | GAADRD2DRD3PIM1CYP11B2 | |
| Pyridine SCHEMBL28869905 | 0.83 | ALDH1A1 (0.50) | GAAALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL24045800 | 0.83 | CYP11B1 (0.55) | GAAPIM1CYP11B2CYP11B1ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL30547501 | 0.83 | ALDH1A1 (0.50) | GAADRD2DRD3CYP11B2CYP11B1 | |
| SCHEMBL11116934 | 0.79 | ALDH1A1 (0.51) | GAADRD2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL30777579 | 0.78 | CYP11B1 (0.60) | GAAPIM1CYP11B2CYP11B1ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3634955-B1 | PIPERIDINONE FORMYL PEPTIDE 2 RECEPTOR AGONISTS | BRISTOL MYERS SQUIBB CO (US) | 2021-03-31 | — | — | EP | disclosed |
| WO-2007026219-A2 | COMBINATIONS OF A 5-HT1B ANTAGONIST WITH A NORADRENALIN RE-UPTAKE INHIBITOR OR A SEROTONIN NORADRENALIN REUTAKE INHIBITOR FOR TREATING CNS CONDITIONS | PFIZER PRODUCTS INC. (US) | 2007-03-08 | — | — | WO | disclosed |